2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-(4-bromo-2,5-dimethyl-phenyl)sulfanyl-N-(4-methyl-3-morpholinosulfonyl-phenyl)acetamide CAS Name: 2-[(4-bromo-2,5-dimethylphenyl)thio]-N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(4-bromo-2,5-dimethylphenyl)sulfanyl-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-[(4-bromo-2,5-dimethyl-phenyl)thio]-N-(4-methyl-3-morpholinosulfonyl-phenyl)acetamide Formula: C21H25BrN2O4S2 MolecularWeight: 513.4682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=C(C=C(C(=C2)C)Br)C)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=C(C=C(C(=C2)C)Br)C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H25BrN2O4S2/c1-14-4-5-17(12-20(14)30(26,27)24-6-8-28-9-7-24)23-21(25)13-29-19-11-15(2)18(22)10-16(19)3/h4-5,10-12H,6-9,13H2,1-3H3,(H,23,25)